| SpectraBase Spectrum ID |
4xohEbXPrd4 |
| Name |
(1S*,4S*,7S*)-1,3,3-Trimethyl-7-cyanobicyclo[2.2.2]oct-5-en-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H15NO |
| InChI |
InChI=1S/C12H15NO/c1-11(2)8-4-5-12(3,10(11)14)9(6-8)7-13/h4-5,8-9H,6H2,1-3H3/t8-,9+,12+/m1/s1 |
| InChIKey |
GOHCQKWNXOKOAF-PTRXPTGYSA-N |
| Molecular Weight |
189.258 g/mol |
| SMILES |
[C@@]12(C(C(C)(C)[C@@](C[C@]2(C#N)[H])(C=C1)[H])=O)C |
| SPLASH |
splash10-014i-4900000000-0d6e2fe0c3a3968ab7e9 |
| Source of Spectrum |
F-69-457-1 |
| Synonyms |
(1S*,4S*,7R*)-1,3,3-Trimethyl-7-cyanobicyclo[2.2.2]oct-5-en-2-one
1,8,8-trimethyl-7-oxobicyclo[2.2.2]oct-5-ene-2-carbonitrile |
| Wiley ID |
1594537 |
![(1S*,4S*,7S*)-1,3,3-Trimethyl-7-cyanobicyclo[2.2.2]oct-5-en-2-one](/api/spectrum/4xohEbXPrd4/structure.png?h=300&w=458 "(1S*,4S*,7S*)-1,3,3-Trimethyl-7-cyanobicyclo[2.2.2]oct-5-en-2-one")
